Vitas-M small molecule compound
3-(3-bromo-4-methoxybenzylidene)-1,5-dioxaspiro[5.5]undecane-2,4-dione
Catalog ID
STK397176
SMILES COc1ccc(cc1Br)C=C1C(=O)OC2(OC1=O)CCCCC2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H17BrO5 MW 381.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17BrO5/c1-21-14-6-5-11(10-13(14)18)9-12-15(19)22-17(23-16(12)20)7-3-2-4-8-17/h5-6,9-10H,2-4,7-8H2,1H3InChIKey
JOTCORZNQPWTPE-UHFFFAOYSA-NSynonyms
3((3BROMO4METHOXYPHENYL)METHYLENE)15DIOXASPIRO(55)UNDECANE24DIONE
3((3bromo4methoxyphenyl)methylidene)15dioxaspiro(55)undecane24dione
3(3bromo4methoxybenzylidene)15dioxaspiro(55)undecane24dione
9((3BROMO4METHOXYPHENYL)METHYLIDENE)711DIOXASPIRO(55)UNDECANE810DIONE
COC1=C(C=C(C=C1)C=C2C(=O)OC3(CCCCC3)OC2=O)Br
InChI=1SC17H17BrO5c121146511(1013(14)18)91215(19)2217(2316(12)20)7324817h56910H2478H21H3
MFCD01874390
ZINC000001405969
ZINC01405969
ZINC1405969
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